material_id
stringlengths
6
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formula_pretty
stringlengths
3
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n_elements
int64
2
8
contains_transition_metal
bool
2 classes
formation_energy_per_atom
float64
-2.33
7.95
energy_per_atom
float64
-16.62
2.06
band_gap
float64
-0.87
5.03
is_semiconductor
bool
2 classes
density
float64
-2.48
10.3
volume
float64
-1.19
19.9
elements
stringlengths
11
46
mp-1100498
Li9Mn7O16
3
true
-0.157124
0.04221
-0.868213
false
0.107448
-0.376194
['Li', 'Mn', 'O']
mp-1100480
Li9Mn7O16
3
true
-0.142707
0.046012
-0.868213
false
0.070351
-0.363798
['Li', 'Mn', 'O']
mp-1100485
Li9Mn7O16
3
true
-0.164674
0.040219
-0.155298
false
0.107871
-0.376334
['Li', 'Mn', 'O']
mp-1100492
Li9Mn7O16
3
true
-0.185833
0.034639
-0.25456
false
0.11212
-0.377731
['Li', 'Mn', 'O']
mp-1100496
Li9Mn7O16
3
true
-0.168981
0.039083
-0.072557
false
0.090955
-0.370727
['Li', 'Mn', 'O']
mp-1100493
Li9Mn7O16
3
true
-0.166381
0.039769
-0.155501
false
0.093833
-0.371685
['Li', 'Mn', 'O']
mp-1100505
Li9Mn7O16
3
true
-0.182855
0.035424
-0.195585
false
0.12158
-0.380824
['Li', 'Mn', 'O']
mp-1100486
Li9Mn7O16
3
true
-0.162747
0.040727
-0.868213
false
0.112726
-0.377929
['Li', 'Mn', 'O']
mp-1100491
Li9Mn7O16
3
true
-0.158053
0.041965
-0.868213
false
0.122238
-0.381039
['Li', 'Mn', 'O']
mp-1100494
Li9Mn7O16
3
true
-0.169384
0.038977
-0.262347
false
0.101956
-0.374381
['Li', 'Mn', 'O']
mp-1100500
Li9Mn7O16
3
true
-0.158204
0.041925
-0.868213
false
0.111163
-0.377416
['Li', 'Mn', 'O']
mp-1100484
Li9Mn7O16
3
true
-0.171101
0.038524
-0.044525
false
0.105627
-0.375594
['Li', 'Mn', 'O']
mp-1100497
Li9Mn7O16
3
true
-0.183762
0.035185
-0.203913
false
0.121582
-0.380825
['Li', 'Mn', 'O']
mp-1100528
Li9Mn7O16
3
true
-0.073648
0.064225
-0.868213
false
0.02584
-0.348445
['Li', 'Mn', 'O']
mp-1100487
Li9Mn7O16
3
true
-0.167616
0.039443
-0.033691
false
0.08942
-0.370214
['Li', 'Mn', 'O']
mp-1175415
Li9Co7O16
3
true
0.278737
0.285914
-0.836796
false
0.4436
-0.443939
['Co', 'Li', 'O']
mp-1175447
Li9Co7O16
3
true
0.300726
0.291713
-0.856905
false
0.377895
-0.425864
['Co', 'Li', 'O']
mp-1175383
Li9Co7O16
3
true
0.305454
0.29296
-0.868213
false
0.337796
-0.414423
['Co', 'Li', 'O']
mp-1175436
Li9Co7O16
3
true
0.305409
0.292948
-0.823051
false
0.343589
-0.416095
['Co', 'Li', 'O']
mp-1175445
Li9Co7O16
3
true
0.301894
0.292021
-0.847291
false
0.347333
-0.417173
['Co', 'Li', 'O']
mp-1175480
Li9Co7O16
3
true
0.310217
0.294216
-0.868213
false
0.401119
-0.432346
['Co', 'Li', 'O']
mp-1175379
Li9Co7O16
3
true
0.293265
0.289745
-0.242914
false
0.373041
-0.424496
['Co', 'Li', 'O']
mp-1175492
Li9Co7O16
3
true
0.312664
0.294861
-0.437106
false
0.371969
-0.424193
['Co', 'Li', 'O']
mp-1175418
Li9Co7O16
3
true
0.275998
0.285191
-0.439272
false
0.466634
-0.450087
['Co', 'Li', 'O']
mp-1175380
Li9Co7O16
3
true
0.29652
0.290604
-0.354093
false
0.395893
-0.430896
['Co', 'Li', 'O']
mp-1175382
Li9Co7O16
3
true
0.300021
0.291527
-0.259909
false
0.346777
-0.417013
['Co', 'Li', 'O']
mp-1175390
Li9Co7O16
3
true
0.302094
0.292074
-0.823118
false
0.340825
-0.415298
['Co', 'Li', 'O']
mp-1175471
Li9Co7O16
3
true
0.33684
0.301237
-0.868213
false
0.382376
-0.427122
['Co', 'Li', 'O']
mp-1176084
Li9Co7O16
3
true
0.432525
0.326472
-0.868213
false
0.333254
-0.413106
['Co', 'Li', 'O']
mp-1175515
Li9Co7O16
3
true
0.399406
0.317738
-0.868213
false
0.314085
-0.407504
['Co', 'Li', 'O']
mp-1175497
Li9Co7O16
3
true
0.362459
0.307994
-0.725616
false
0.286957
-0.399445
['Co', 'Li', 'O']
mp-1175571
Li9Co7O16
3
true
0.288537
0.288498
-0.652084
false
0.441839
-0.443465
['Co', 'Li', 'O']
mp-1175514
Li9Co7O16
3
true
0.381158
0.312925
-0.868213
false
0.314212
-0.407542
['Co', 'Li', 'O']
mp-1222566
Li9Mn3N4
3
true
1.735363
0.581597
-0.868213
false
-0.811959
-0.702618
['Li', 'Mn', 'N']
mp-761270
Li9Cr5O12
3
false
-0.317687
0.062028
0.106264
true
-0.092335
-0.55527
['Cr', 'Li', 'O']
mp-764889
Li9Fe5O12
3
true
0.067318
0.229575
-0.679235
false
-0.073771
-0.535124
['Fe', 'Li', 'O']
mp-767704
Li9Mn15O32
3
true
-0.048398
-0.095444
-0.868213
false
0.298864
0.35964
['Li', 'Mn', 'O']
mp-779050
Li9V14O35
3
false
-0.490784
-0.179155
-0.525128
false
-0.433998
2.891545
['Li', 'O', 'V']
mp-767516
Li9Sb3S
3
false
1.335607
1.138714
-0.840181
false
-0.511007
1.714882
['Li', 'S', 'Sb']
mp-779282
Li9Bi5O13
3
false
0.182334
0.501969
-0.487278
false
1.290594
3.204068
['Bi', 'Li', 'O']
mp-1176815
Li9Mn5O12
3
true
-0.093612
0.148521
0.049117
true
-0.142769
0.196603
['Li', 'Mn', 'O']
mp-1175466
Li9Co7O16
3
true
0.31673
0.295934
-0.868213
false
0.428536
-0.439866
['Co', 'Li', 'O']
mp-676215
Li9Ta11N20
3
false
1.537995
-3.412958
-0.868213
false
3.50446
0.006457
['Li', 'N', 'Ta']
mp-1100502
Li9Mn7O16
3
true
-0.160461
0.04133
-0.525602
false
0.114028
-0.378356
['Li', 'Mn', 'O']
mp-1100501
Li9Mn7O16
3
true
-0.165553
0.039987
-0.469606
false
0.120898
-0.380602
['Li', 'Mn', 'O']
mp-1100507
Li9Mn7O16
3
true
-0.163965
0.040406
-0.556342
false
0.121991
-0.380958
['Li', 'Mn', 'O']
mp-1100506
Li9Mn7O16
3
true
-0.165248
0.040068
-0.489445
false
0.121701
-0.380864
['Li', 'Mn', 'O']
mp-1100508
Li9Mn7O16
3
true
-0.165682
0.039953
-0.44584
false
0.116416
-0.379138
['Li', 'Mn', 'O']
mp-1100514
Li9Mn7O16
3
true
-0.183057
0.035371
-0.355109
false
0.113138
-0.378064
['Li', 'Mn', 'O']
mp-1100518
Li9Mn7O16
3
true
-0.174997
0.037497
-0.868213
false
0.113295
-0.378116
['Li', 'Mn', 'O']
mp-1100519
Li9Mn7O16
3
true
-0.180673
0.036
-0.461413
false
0.1044
-0.375189
['Li', 'Mn', 'O']
mp-1100521
Li9Mn7O16
3
true
-0.165861
0.039906
-0.480914
false
0.095902
-0.372374
['Li', 'Mn', 'O']
mp-1100513
Li9Mn7O16
3
true
-0.169691
0.038896
-0.458434
false
0.111161
-0.377416
['Li', 'Mn', 'O']
mp-1100524
Li9Mn7O16
3
true
-0.17735
0.036876
-0.868213
false
0.101759
-0.374316
['Li', 'Mn', 'O']
mp-1100512
Li9Mn7O16
3
true
-0.166018
0.039865
-0.467643
false
0.096124
-0.372448
['Li', 'Mn', 'O']
mp-1100516
Li9Mn7O16
3
true
-0.176343
0.037142
-0.868213
false
0.111633
-0.377571
['Li', 'Mn', 'O']
mp-1100520
Li9Mn7O16
3
true
-0.179174
0.036395
-0.470216
false
0.095402
-0.372208
['Li', 'Mn', 'O']
mp-1100523
Li9Mn7O16
3
true
-0.181187
0.035864
-0.296337
false
0.097884
-0.373032
['Li', 'Mn', 'O']
mp-1100503
Li9Mn7O16
3
true
-0.141376
0.046363
-0.868213
false
0.075045
-0.365386
['Li', 'Mn', 'O']
mp-1100517
Li9Mn7O16
3
true
-0.179912
0.0362
-0.430538
false
0.109328
-0.376813
['Li', 'Mn', 'O']
mp-1100526
Li9Mn7O16
3
true
-0.181919
0.035671
-0.404402
false
0.108323
-0.376482
['Li', 'Mn', 'O']
mp-1100504
Li9Mn7O16
3
true
-0.141399
0.046357
-0.868213
false
0.081389
-0.367523
['Li', 'Mn', 'O']
mp-1100511
Li9Mn7O16
3
true
-0.165954
0.039881
-0.388625
false
0.103449
-0.374875
['Li', 'Mn', 'O']
mp-1100509
Li9Mn7O16
3
true
-0.161102
0.041161
-0.559457
false
0.107555
-0.376229
['Li', 'Mn', 'O']
mp-1100510
Li9Mn7O16
3
true
-0.168126
0.039309
-0.410428
false
0.093632
-0.371619
['Li', 'Mn', 'O']
mp-1100515
Li9Mn7O16
3
true
-0.174966
0.037505
-0.868213
false
0.114464
-0.378499
['Li', 'Mn', 'O']
mp-1100522
Li9Mn7O16
3
true
-0.179571
0.03629
-0.49906
false
0.119209
-0.380051
['Li', 'Mn', 'O']
mp-1100530
Li9Mn7O16
3
true
-0.175814
0.037281
-0.868213
false
0.094931
-0.372051
['Li', 'Mn', 'O']
mp-1100541
Li9Mn7O16
3
true
-0.187699
0.034147
-0.237497
false
0.103392
-0.374856
['Li', 'Mn', 'O']
mp-1100531
Li9Mn7O16
3
true
-0.174187
0.03771
-0.868213
false
0.116103
-0.379036
['Li', 'Mn', 'O']
mp-1100533
Li9Mn7O16
3
true
-0.16523
0.040072
-0.868213
false
0.12246
-0.381111
['Li', 'Mn', 'O']
mp-1100536
Li9Mn7O16
3
true
-0.186548
0.03445
-0.236008
false
0.12295
-0.381271
['Li', 'Mn', 'O']
mp-1100549
Li9Mn7O16
3
true
-0.18576
0.034658
-0.266545
false
0.094675
-0.371966
['Li', 'Mn', 'O']
mp-1100554
Li9Mn7O16
3
true
-0.183716
0.035197
-0.20845
false
0.109571
-0.376893
['Li', 'Mn', 'O']
mp-1100555
Li9Mn7O16
3
true
-0.181229
0.035853
-0.434871
false
0.118803
-0.379919
['Li', 'Mn', 'O']
mp-1100537
Li9Mn7O16
3
true
-0.174627
0.037594
-0.868213
false
0.12055
-0.380489
['Li', 'Mn', 'O']
mp-1100547
Li9Mn7O16
3
true
-0.176863
0.037004
-0.868213
false
0.119224
-0.380056
['Li', 'Mn', 'O']
mp-1100558
Li9Mn7O16
3
true
-0.178875
0.036474
-0.463715
false
0.122972
-0.381278
['Li', 'Mn', 'O']
mp-1100534
Li9Mn7O16
3
true
-0.174976
0.037502
-0.868213
false
0.120625
-0.380513
['Li', 'Mn', 'O']
mp-1100535
Li9Mn7O16
3
true
-0.174494
0.037629
-0.394042
false
0.072163
-0.364412
['Li', 'Mn', 'O']
mp-1100540
Li9Mn7O16
3
true
-0.184469
0.034998
-0.180012
false
0.119453
-0.380131
['Li', 'Mn', 'O']
mp-1100542
Li9Mn7O16
3
true
-0.174404
0.037653
-0.868213
false
0.105725
-0.375626
['Li', 'Mn', 'O']
mp-1100539
Li9Mn7O16
3
true
-0.176589
0.037077
-0.868213
false
0.117895
-0.379622
['Li', 'Mn', 'O']
mp-1100543
Li9Mn7O16
3
true
-0.176446
0.037114
-0.868213
false
0.101987
-0.374392
['Li', 'Mn', 'O']
mp-1100551
Li9Mn7O16
3
true
-0.185891
0.034623
-0.288212
false
0.112847
-0.377969
['Li', 'Mn', 'O']
mp-1100552
Li9Mn7O16
3
true
-0.179565
0.036292
-0.460601
false
0.121027
-0.380644
['Li', 'Mn', 'O']
mp-1100557
Li9Mn7O16
3
true
-0.185393
0.034755
-0.27379
false
0.092279
-0.371168
['Li', 'Mn', 'O']
mp-1100529
Li9Mn7O16
3
true
-0.174793
0.03755
-0.868213
false
0.111548
-0.377543
['Li', 'Mn', 'O']
mp-1100532
Li9Mn7O16
3
true
-0.174592
0.037603
-0.868213
false
0.107386
-0.376174
['Li', 'Mn', 'O']
mp-1100545
Li9Mn7O16
3
true
-0.176865
0.037004
-0.868213
false
0.11766
-0.379545
['Li', 'Mn', 'O']
mp-1100553
Li9Mn7O16
3
true
-0.186502
0.034462
-0.243727
false
0.10479
-0.375318
['Li', 'Mn', 'O']
mp-1100538
Li9Mn7O16
3
true
-0.17508
0.037475
-0.868213
false
0.12264
-0.38117
['Li', 'Mn', 'O']
mp-1100546
Li9Mn7O16
3
true
-0.176844
0.037009
-0.868213
false
0.120242
-0.380388
['Li', 'Mn', 'O']
mp-1100556
Li9Mn7O16
3
true
-0.185133
0.034823
-0.292275
false
0.114068
-0.378369
['Li', 'Mn', 'O']
mp-1100559
Li9Mn7O16
3
true
-0.176871
0.037002
-0.868213
false
0.100494
-0.373897
['Li', 'Mn', 'O']
mp-1100544
Li9Mn7O16
3
true
-0.176885
0.036999
-0.868213
false
0.115858
-0.378956
['Li', 'Mn', 'O']
mp-1100562
Li9Mn7O16
3
true
-0.180228
0.036117
-0.436496
false
0.105541
-0.375566
['Li', 'Mn', 'O']
mp-1175405
Li9Co7O16
3
true
0.290548
0.289029
-0.864624
false
0.427955
-0.439708
['Co', 'Li', 'O']
mp-1175374
Li9Co7O16
3
true
0.286103
0.287856
-0.396073
false
0.463621
-0.449288
['Co', 'Li', 'O']
mp-1175409
Li9Co7O16
3
true
0.247874
0.277774
-0.783576
false
0.713158
-0.510378
['Co', 'Li', 'O']